N'-(2-methyl-5-nitro-phenyl)-N-[(2S)-2-oxidanylpropyl]ethanediamide

Systemtic Name: N'-(2-methyl-5-nitro-phenyl)-N-[(2S)-2-oxidanylpropyl]ethanediamide Openeye Name: N-[(2S)-2-hydroxypropyl]-N'-(2-methyl-5-nitro-phenyl)oxamide CAS Name: N-[(2S)-2-hydroxypropyl]-N'-(2-methyl-5-nitrophenyl)oxamide IUPAC Name: N-[(2S)-2-hydroxypropyl]-N'-(2-methyl-5-nitrophenyl)oxamide Traditional Name: N-[(2S)-2-hydroxypropyl]-N'-(2-methyl-5-nitro-phenyl)oxamide Formula: C12H15N3O5 MolecularWeight: 281.2646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(=O)NCC(C)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(=O)NC[C@H](C)O

InChI

InChI=1S/C12H15N3O5/c1-7-3-4-9(15(19)20)5-10(7)14-12(18)11(17)13-6-8(2)16/h3-5,8,16H,6H2,1-2H3,(H,13,17)(H,14,18)/t8-/m0/s1